First-Principles Simulation and Materials Screening for Spin-Orbit Torque in 2D van der Waals Heterostructures.
Small
; 20(33): e2308965, 2024 Aug.
Article
in En
| MEDLINE
| ID: mdl-38693077
ABSTRACT
Recent advancements in spin-orbit torque (SOT) technology in two-dimensional van der Waals (2D vdW) materials have not only pushed spintronic devices to their atomic limits but have also unveiled unconventional torques and novel spin-switching mechanisms. The vast diversity of SOT observed in numerous 2D vdW materials necessitates a screening strategy to identify optimal materials for torque device performance. However, such a strategy has yet to be established. To address this critical issue, a combination of density functional theory and non-equilibrium Green's function is employed to calculate the SOT in various 2D vdW bilayer heterostructures. This leads to the discovery of three high SOT systems WTe2/CrSe2, MoTe2/VS2, and NbSe2/CrSe2. Furthermore, a figure of merit that allows for rapid and efficient estimation of SOT is proposed, enabling high-throughput screening of optimal materials and devices for SOT applications in the future.
Full text:
1
Collection:
01-internacional
Database:
MEDLINE
Language:
En
Journal:
Small
/
Small (Weinh., Internet)
/
Small (Weinheim. Internet)
Journal subject:
ENGENHARIA BIOMEDICA
Year:
2024
Document type:
Article
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